SCHEMBL15330288

SCHEMBL15330288

CCC(CC)NC(=O)Cn1nc(C)c(C=O)c1C

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.44
HTT P42858 3/20 0.44
ATM Q13315 2/20 0.40
ALDH1A1 P00352 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
LMNA P02545 3/20 0.35
TP53 P04637 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2559016 0.89 HTT (0.47) POLBHTTATMALDH1A1LMNA
SCHEMBL2554897 0.86 HTT (0.59) POLBHTTATMALDH1A1TP53
SCHEMBL15332321 0.81 GAA (0.41) POLBHTTATMALDH1A1LMNA
SCHEMBL2562893 0.81 RAB9A (0.48) POLBHTTATMALDH1A1LMNA
SCHEMBL15331266 0.77 MEN1 (0.54) ATMALDH1A1LMNATP53NPC1
SCHEMBL15329735 0.77 HPGD (0.38) POLBHTTATMALDH1A1LMNA
SCHEMBL2556249 0.76 TSHR (0.42) POLBHTTATMALDH1A1LMNA
SCHEMBL15331246 0.75 KMT2A (0.43) ALDH1A1TP53NPC1RAB9ASMN1; SMN2
SCHEMBL15330117 0.75 GAA (0.38) POLBHTTATMALDH1A1LMNA
SCHEMBL2555624 0.75 GAA (0.38) POLBHTTATMALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed